(2-ethylcyclohexyl) 2-aminoacetate

C10H19NO2 — CID 61277444

IUPAC(2-ethylcyclohexyl) 2-aminoacetate
SMILESCCC1CCCCC1OC(=O)CN
InChIInChI=1S/C10H19NO2/c1-2-8-5-3-4-6-9(8)13-10(12)7-11/h8-9H,2-7,11H2,1H3
InChIKeyWFDSCPOLOJTNFF-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.46
Rot. Bonds3

About (2-ethylcyclohexyl) 2-aminoacetate

(2-ethylcyclohexyl) 2-aminoacetate (PubChem CID 61277444) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (2-ethylcyclohexyl) 2-aminoacetate.

Molecular Properties

Compound Name(2-ethylcyclohexyl) 2-aminoacetate
PubChem CID61277444
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(2-ethylcyclohexyl) 2-aminoacetate
SMILESCCC1CCCCC1OC(=O)CN
InChIInChI=1S/C10H19NO2/c1-2-8-5-3-4-6-9(8)13-10(12)7-11/h8-9H,2-7,11H2,1H3
InChIKeyWFDSCPOLOJTNFF-UHFFFAOYSA-N
XLogP1.46
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-ethylcyclohexyl) 2-aminoacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl) 2-aminoacetate?
The IUPAC name of (2-ethylcyclohexyl) 2-aminoacetate (CID 61277444) is (2-ethylcyclohexyl) 2-aminoacetate.
What is the SMILES notation for (2-ethylcyclohexyl) 2-aminoacetate?
The canonical SMILES for (2-ethylcyclohexyl) 2-aminoacetate is CCC1CCCCC1OC(=O)CN.
What is the InChIKey of (2-ethylcyclohexyl) 2-aminoacetate?
The InChIKey is WFDSCPOLOJTNFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-8-5-3-4-6-9(8)13-10(12)7-11/h8-9H,2-7,11H2,1H3.
What are the key properties of (2-ethylcyclohexyl) 2-aminoacetate?
(2-ethylcyclohexyl) 2-aminoacetate has a molecular weight of 185.27 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl) 2-aminoacetate is sourced from PubChem (CID 61277444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).